diff options
| author | Andreas Maunz <andreas@maunz.de> | 2012-04-02 09:18:14 +0200 |
|---|---|---|
| committer | Andreas Maunz <andreas@maunz.de> | 2012-04-02 09:18:14 +0200 |
| commit | 3cd136861c68b8c24cc653c903c620d55be4b294 (patch) | |
| tree | ab50372c9ed9cab413e72b62f219d23ca481e935 /java/resources/smartsEvaluation/trans_butene.mol | |
| parent | cb67fe0e722a58b6fcf212ef045808dc9a13053a (diff) | |
Remove PC descriptor
Diffstat (limited to 'java/resources/smartsEvaluation/trans_butene.mol')
| -rw-r--r-- | java/resources/smartsEvaluation/trans_butene.mol | 12 |
1 files changed, 0 insertions, 12 deletions
diff --git a/java/resources/smartsEvaluation/trans_butene.mol b/java/resources/smartsEvaluation/trans_butene.mol deleted file mode 100644 index 5739624..0000000 --- a/java/resources/smartsEvaluation/trans_butene.mol +++ /dev/null @@ -1,12 +0,0 @@ -trans-butene
- -ISIS- 2D
-Used JOELib chemistry kernel (expert systems) ID is 715333816
- 4 3 0 0 0 0 0 0 0 0 1 V2000
- 16.8848 -2.5852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
- 16.2197 -3.7371 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
- 14.8896 -3.7371 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
- 14.2246 -4.8890 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
- 1 2 1 0 0 0 0
- 2 3 2 0 0 0 0
- 3 4 1 0 0 0 0
-M END
|